CHEMBL3287406


SMILES N#Cc1cc2cc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)ccn2n1
InChIKey TXMVXDBYJCUQJD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 443.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Human Dopamine A pKi 5.46 5.46 5.46 ChEMBL
D4 DRD4 Human Dopamine A pKi 8.03 8.03 8.03 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.09 7.09 7.09 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.72 8.72 8.72 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.05 8.11 8.17 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 7.39 7.39 7.39 ChEMBL
D2 DRD2 Human Dopamine A pEC50 7.01 7.01 7.01 ChEMBL